| 1 |
Fully flexible low-mode docking: Application to induced fit in HIV integrase
Keseru GM, Kolossvary I
Journal of the American Chemical Society, 123(50), 12708, 2001 |
| 2 |
Theoretical study of alternative ring forms of alpha-L-fucopyranose
Csonka GI, Elias K, Kolossvary I, Sosa CP, Csizmadia IG
Journal of Physical Chemistry A, 102(7), 1219, 1998 |
| 3 |
Evaluation of the molecular configuration integral in all degrees of freedom for the direct calculation of conformational free energies: Prediction of the anomeric free energy of monosaccharides
Kolossvary I
Journal of Physical Chemistry A, 101(51), 9900, 1997 |
| 4 |
Cytochrome-P-450 Catalyzed Insecticide Metabolism - Prediction of Regioselectivity and Stereoselectivity in the Primer Metabolism of Carbofuran - A Theoretical-Study
Keseru GM, Kolossvary I, Bertok B
Journal of the American Chemical Society, 119(22), 5126, 1997 |
| 5 |
Evaluation of the molecular configuration integral in all degrees of freedom for the direct calculation of binding free energies: Application to the enantioselective binding of amino acid derivatives to synthetic host molecules
Kolossvary I
Journal of the American Chemical Society, 119(42), 10233, 1997 |
| 6 |
Molecular-Dynamics Simulation of Cyclodextrin Inclusion Complexes in Enzymatic Lipid Hydrolysis
Kolossvary GJ, Kolossvary I
Biotechnology Letters, 18(4), 440, 1996 |
| 7 |
Low Mode Search - An Efficient, Automated Computational Method for Conformational-Analysis - Application to Cyclic and Acyclic Alkanes and Cyclic-Peptides
Kolossvary I, Guida WC
Journal of the American Chemical Society, 118(21), 5011, 1996 |
